(3β,16β,18α,19α)-Urs-20-ene-3,16,30-triol

CAS Registry Number®

71876-59-0

CAS Name

(3β,16β,18α,19α)-Urs-20-ene-3,16,30-triol

Molecular Formula

C30H50O3

Molecular Mass

458.72

Cite this Page

(3β,16β,18α,19α)-Urs-20-ene-3,16,30-triol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=71876-59-0 (retrieved 2024-12-23) (CAS RN: 71876-59-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C30H50O3/c1-18-19(17-31)10-13-28(5)24(33)16-30(7)20(25(18)28)8-9-22-27(4)14-12-23(32)26(2,3)21(27)11-15-29(22,30)6/h10,18,20-25,31-33H,8-9,11-17H2,1-7H3/t18-,20-,21+,22-,23+,24+,25-,27+,28-,29-,30-/m1/s1

InChIKey

InChIKey=IWSSUQMYGYYLOJ-LKFLZPLESA-N

SMILES

C[C@]12[C@@]3(C)[C@@]([C@@]4([C@@](C)([C@@H](O)C3)CC=C(CO)[C@H]4C)[H])(CC[C@@]1([C@]5(C)[C@@](CC2)(C(C)(C)[C@@H](O)CC5)[H])[H])[H]

Canonical SMILES

OCC1=CCC2(C)C(O)CC3(C)C(CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1C

Other Names for this Substance

  • Urs-20-ene-3,16,30-triol, (3β,16β,18α,19α)-
  • (3β,16β,18α,19α)-Urs-20-ene-3,16,30-triol
  • Heliantriol F

CAS INSIGHTSTM
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